Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5205660

NC(=O)c1sc2c(c1C(=O)NCC1CC1)CCCC2.NCc1cccc(C(=O)N(CC(=O)O)c2ccccc2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 2/20 0.38
CNR2 P34972 1/20 0.37
KMT2A Q03164 3/20 0.36
PTGER4 P35408 1/20 0.36
TAAR1 Q96RJ0 2/20 0.36
FLT3 P36888 5/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
MAPT P10636 4/20 0.35
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 2/20 0.34
CASP3 P42574 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
MGAM O43451 1/20 0.33
AMY1A P0DUB6 1/20 0.33
F10 P00742 1/20 0.33
PRSS1 P07477 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Trifluoroacetic Acid SCHEMBL5207372 0.92 RORC (0.47) RORCKMT2ATAAR1FLT3NPC1
Trifluoroacetic Acid SCHEMBL5204002 0.89 FLT3 (0.38) RORCKMT2ATAAR1FLT3NPC1
Trifluoroacetic Acid SCHEMBL5209718 0.89 FLT3 (0.39) RORCKMT2ATAAR1FLT3NPC1
Trifluoroacetic Acid SCHEMBL5205740 0.89 RORC (0.38) RORCKMT2ATAAR1FLT3NPC1
Trifluoroacetic Acid SCHEMBL5211954 0.89 FLT3 (0.37) RORCKMT2ATAAR1FLT3NPC1
Trifluoroacetic Acid SCHEMBL5204823 0.87 AMY1A (0.48) RORCKMT2AFLT3NPC1RAB9A
Trifluoroacetic Acid SCHEMBL5210994 0.87 MAPT (0.43) RORCKMT2ARAB9AMAPTALDH1A1
Trifluoroacetic Acid SCHEMBL5280152 0.87 ALDH1A1 (0.40) RORCCNR2KMT2AFLT3NPC1
Trifluoroacetic Acid SCHEMBL5208332 0.86 FLT3 (0.35) RORCKMT2AFLT3NPC1RAB9A
Trifluoroacetic Acid SCHEMBL5628234 0.85 ALDH1A1 (0.38) RORCCNR2KMT2AFLT3NPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1343561-B1 SERINE PROTEASE INHIBITORS TULARIK LTD (GB) 2007-02-28 EP disclosed